2-[4-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]carbonyl-3-(2-carboxyphenyl)carbonyloxy-phenoxy]carbonylbenzoic acid

Systemtic Name: 2-[4-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]carbonyl-3-(2-carboxyphenyl)carbonyloxy-phenoxy]carbonylbenzoic acid Openeye Name: 2-[4-[2-(4-bromophenyl)-2-oxo-ethoxy]carbonyl-3-(2-carboxybenzoyl)oxy-phenoxy]carbonylbenzoic acid CAS Name: 2-[[4-[[2-(4-bromophenyl)-2-oxoethoxy]-oxomethyl]-3-[(2-carboxyphenyl)-oxomethoxy]phenoxy]-oxomethyl]benzoic acid IUPAC Name: 2-[4-[2-(4-bromophenyl)-2-oxoethoxy]carbonyl-3-(2-carboxybenzoyl)oxyphenoxy]carbonylbenzoic acid Traditional Name: 2-[4-[2-(4-bromophenyl)-2-keto-ethoxy]carbonyl-3-(2-carboxybenzoyl)oxy-phenoxy]carbonylbenzoic acid Formula: C31H19BrO11 MolecularWeight: 647.37996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)C(=O)OC2=CC(=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)OC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)C(=O)OC2=CC(=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)OC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C31H19BrO11/c32-18-11-9-17(10-12-18)25(33)16-41-29(38)24-14-13-19(42-30(39)22-7-3-1-5-20(22)27(34)35)15-26(24)43-31(40)23-8-4-2-6-21(23)28(36)37/h1-15H,16H2,(H,34,35)(H,36,37)